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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Rho-associated protein kinase 2' and Ligand = 'BDBM50286629'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Rho-associated protein kinase 2


(Homo sapiens (Human))		BDBM50286629
PNG
(CHEMBL4163816)
Show SMILES [H][C@]12[C@H](O)[C@@H](Cl)CCN1[C@@H](\C=C(/C)\C=C\C1CC1)[C@H](O)[C@@]2(C)O |r|
Show InChI InChI=1S/C17H26ClNO3/c1-10(3-4-11-5-6-11)9-13-16(21)17(2,22)15-14(20)12(18)7-8-19(13)15/h3-4,9,11-16,20-22H,5-8H2,1-2H3/b4-3+,10-9+/t12-,13-,14+,15+,16-,17-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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GoogleScholar
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PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Inhibition of ROCK2 (unknown origin) using SKT S2 as substrate measured after 30 mins by HTRF assay

J Nat Prod 81: 394-399 (2018)


Article DOI: 10.1021/acs.jnatprod.7b01055
BindingDB Entry DOI: 10.7270/Q20P12JW
More data for this
Ligand-Target Pair